N-[2-aminocarbonyl-4-(trifluoromethyl)phenyl]-4-propan-2-yl-piperazine-1-carboxamide hydrochloride

Systemtic Name: N-[2-aminocarbonyl-4-(trifluoromethyl)phenyl]-4-propan-2-yl-piperazine-1-carboxamide hydrochloride Openeye Name: N-[2-carbamoyl-4-(trifluoromethyl)phenyl]-4-isopropyl-piperazine-1-carboxamide hydrochloride CAS Name: N-[2-carbamoyl-4-(trifluoromethyl)phenyl]-4-propan-2-yl-1-piperazinecarboxamide hydrochloride IUPAC Name: N-[2-carbamoyl-4-(trifluoromethyl)phenyl]-4-propan-2-ylpiperazine-1-carboxamide hydrochloride Traditional Name: N-[2-carbamoyl-4-(trifluoromethyl)phenyl]-4-isopropyl-piperazine-1-carboxamide hydrochloride Formula: C16H22ClF3N4O2 MolecularWeight: 394.81969

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(CC1)C(=O)NC2=C(C=C(C=C2)C(F)(F)F)C(=O)N.Cl

Isomeric SMILES

CC(C)N1CCN(CC1)C(=O)NC2=C(C=C(C=C2)C(F)(F)F)C(=O)N.Cl

InChI

InChI=1S/C16H21F3N4O2.ClH/c1-10(2)22-5-7-23(8-6-22)15(25)21-13-4-3-11(16(17,18)19)9-12(13)14(20)24;/h3-4,9-10H,5-8H2,1-2H3,(H2,20,24)(H,21,25);1H